SCHEMBL14995998

SCHEMBL14995998

CCCCc1cc2c(CCC)c(O)c(O)cc2c(O)c1-c1c(CCCC)cc2c(CCC)c(O)c(O)cc2c1O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BCL2L1 Q07817 3/20 0.47
BCL2 P10415 1/20 0.47
MCL1 Q07820 1/20 0.47
BCL2A1 Q16548 1/20 0.47
TYR P14679 3/20 0.40
HTT P42858 2/20 0.39
NPC1 O15118 1/20 0.39
HPGD P15428 1/20 0.39
MAPK1 P28482 1/20 0.39
RAB9A P51151 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
ALOX5 P09917 5/20 0.38
LDHA P00338 3/20 0.37
LDHB P07195 3/20 0.37
MEN1 O00255 1/20 0.35
TP53 P04637 1/20 0.35
CYP3A4 P08684 1/20 0.35
MAPT P10636 1/20 0.35
ALOX15 P16050 1/20 0.35
TSHR P16473 1/20 0.35

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL14995997 0.92 BCL2L1 (0.50) BCL2L1BCL2MCL1BCL2A1ALOX5
SCHEMBL14995995 0.91 BCL2L1 (0.43) BCL2L1BCL2MCL1BCL2A1TYR
SCHEMBL14995987 0.87 BCL2L1 (0.51) BCL2L1BCL2MCL1BCL2A1HPGD
SCHEMBL14995986 0.84 BCL2L1 (0.46) BCL2L1BCL2MCL1BCL2A1ALOX5
SCHEMBL14995985 0.83 TYR (0.41) BCL2L1BCL2MCL1BCL2A1TYR
SCHEMBL14995970 0.81 BCL2L1 (0.64) BCL2L1BCL2MCL1BCL2A1HTT
SCHEMBL14995965 0.79 BCL2L1 (0.66) BCL2L1BCL2MCL1BCL2A1LDHA
SCHEMBL14995966 0.76 BCL2L1 (0.42) BCL2L1BCL2MCL1BCL2A1TYR
SCHEMBL14995968 0.75 BCL2L1 (0.43) BCL2L1BCL2MCL1BCL2A1TYR
SCHEMBL5920126 0.75 HTT (0.48) TYRHTTNPC1HPGDMAPK1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8455540-B2 Gossypol and apogossypol derivatives, preparation thereof and uses thereof UNIVERSITE DU MAINE (LE MANS) (FR) 2013-06-04 US disclosed